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#1 2022-03-08 20:18:33
- Mohammed Obies AL-Nafee
- Member
- Registered: 2022-03-08
- Posts: 2
memory error
Hi,
I am trying to run CASSCF calculation on quit big system and I got this error
?mma_allo_?D: error: out-of-memory
available (kB): 12958
required (kB): 135532How can increase the memory in my input, i.e. what keyword should I use?
Thank you in advanced,
Mohammed
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#2 2022-03-09 09:14:17
- Ignacio
- Administrator
- From: Uppsala
- Registered: 2015-11-03
- Posts: 1,085
Re: memory error
Define the environment variable MOLCAS_MEM, either before launching the calculation or in the input file with `> EXPORT`. See https://molcas.gitlab.io/OpenMolcas/sph … -variables
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